4-[(1R)-1-(dimethylamino)-2-methylpropyl]-N-methylbenzamide

C14H22N2O — CID 118928753

IUPAC4-[(1R)-1-(dimethylamino)-2-methylpropyl]-N-methylbenzamide
SMILESCNC(=O)c1ccc([C@@H](C(C)C)N(C)C)cc1
InChIInChI=1S/C14H22N2O/c1-10(2)13(16(4)5)11-6-8-12(9-7-11)14(17)15-3/h6-10,13H,1-5H3,(H,15,17)/t13-/m1/s1
InChIKeyYKYIBLXAOVYRON-CYBMUJFWSA-N
MW234.34 g/mol
LogP2.30
Rot. Bonds4

About 4-[(1R)-1-(dimethylamino)-2-methylpropyl]-N-methylbenzamide

4-[(1R)-1-(dimethylamino)-2-methylpropyl]-N-methylbenzamide (PubChem CID 118928753) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 4-[(1R)-1-(dimethylamino)-2-methylpropyl]-N-methylbenzamide.

Molecular Properties

Compound Name4-[(1R)-1-(dimethylamino)-2-methylpropyl]-N-methylbenzamide
PubChem CID118928753
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name4-[(1R)-1-(dimethylamino)-2-methylpropyl]-N-methylbenzamide
SMILESCNC(=O)c1ccc([C@@H](C(C)C)N(C)C)cc1
InChIInChI=1S/C14H22N2O/c1-10(2)13(16(4)5)11-6-8-12(9-7-11)14(17)15-3/h6-10,13H,1-5H3,(H,15,17)/t13-/m1/s1
InChIKeyYKYIBLXAOVYRON-CYBMUJFWSA-N
XLogP2.30
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-[(1R)-1-(dimethylamino)-2-methylpropyl]-N-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[(1R,2R)-1-(dimethylamino)-2,3,3-trimethylbutyl]-N-methylbenzamide
CID 130470007
N-methyl-4-(1-methylsulfanylethyl)benzamide
CID 59428965
N-[(1S,2R)-1-(dimethylamino)-1-phenylpropan-2-yl]benzamide
CID 51696070
1-N-methyl-4-N,4-N-di(propan-2-yl)benzene-1,4-dicarboxamide
CID 793999
N-methyl-N-[3-[4-(methylcarbamoyl)phenyl]butyl]-4-propan-2-ylbenzamide
CID 134213133
ethane;N-methylbenzamide;2-methylpropane
CID 161462553
4-[4-(dimethylamino)phenyl]-N-methylbenzamide
CID 110487764
N-methylbenzamide
CID 11954
4-[[2-aminopropanoyl(methyl)amino]methyl]-N-methylbenzamide
CID 54871424
4-[[2-bromopropanoyl(methyl)amino]methyl]-N-methylbenzamide
CID 114014417
4-[[(2R)-2-amino-3-methylbutanoyl]amino]-N-methylbenzamide
CID 79011407
1-N,4-N-dimethylbenzene-1,4-dicarboxamide;dimethyl benzene-1,4-dicarboxylate
CID 158994697

Frequently Asked Questions

What is the IUPAC name of 4-[(1R)-1-(dimethylamino)-2-methylpropyl]-N-methylbenzamide?
The IUPAC name of 4-[(1R)-1-(dimethylamino)-2-methylpropyl]-N-methylbenzamide (CID 118928753) is 4-[(1R)-1-(dimethylamino)-2-methylpropyl]-N-methylbenzamide.
What is the SMILES notation for 4-[(1R)-1-(dimethylamino)-2-methylpropyl]-N-methylbenzamide?
The canonical SMILES for 4-[(1R)-1-(dimethylamino)-2-methylpropyl]-N-methylbenzamide is CNC(=O)c1ccc([C@@H](C(C)C)N(C)C)cc1.
What is the InChIKey of 4-[(1R)-1-(dimethylamino)-2-methylpropyl]-N-methylbenzamide?
The InChIKey is YKYIBLXAOVYRON-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H22N2O/c1-10(2)13(16(4)5)11-6-8-12(9-7-11)14(17)15-3/h6-10,13H,1-5H3,(H,15,17)/t13-/m1/s1.
What are the key properties of 4-[(1R)-1-(dimethylamino)-2-methylpropyl]-N-methylbenzamide?
4-[(1R)-1-(dimethylamino)-2-methylpropyl]-N-methylbenzamide has a molecular weight of 234.34 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1R)-1-(dimethylamino)-2-methylpropyl]-N-methylbenzamide is sourced from PubChem (CID 118928753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).